6-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]piperidin-2-yl]carbonylpyridine-3-carboximidamide

Systemtic Name: 6-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]piperidin-2-yl]carbonylpyridine-3-carboximidamide Openeye Name: 6-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]piperidine-2-carbonyl]pyridine-3-carboxamidine CAS Name: 6-[[1-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-2-piperidinyl]-oxomethyl]-3-pyridinecarboximidamide IUPAC Name: 6-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]piperidine-2-carbonyl]pyridine-3-carboximidamide Traditional Name: 6-(1-tyrosylpipecoloyl)nicotinamidine Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)C2=NC=C(C=C2)C(=N)N)C(=O)C(CC3=CC=C(C=C3)O)N

Isomeric SMILES

C1CCN(C(C1)C(=O)C2=NC=C(C=C2)C(=N)N)C(=O)C(CC3=CC=C(C=C3)O)N

InChI

InChI=1S/C21H25N5O3/c22-16(11-13-4-7-15(27)8-5-13)21(29)26-10-2-1-3-18(26)19(28)17-9-6-14(12-25-17)20(23)24/h4-9,12,16,18,27H,1-3,10-11,22H2,(H3,23,24)